0 mol 45 unq 0 iso 0 dist 9.69419 6.74214 7.18002 6.1517 4.80098 7.55443 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.02004 3.47529 9.54119 8.12546 6.21973 7.05964 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.02004 3.47529 9.54119 10.1113 17.4974 9.90758 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 6.35042 12.4809 9.54119 10.8442 6.21973 7.05964 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 6.35042 12.4809 9.54119 20.0234 17.4974 9.90758 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 7.77714 3.42062 9.77004 8.06519 14.0438 7.32699 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 7.77714 3.42062 9.77004 7.54027 10.6879 6.45933 numMergedOcc 0
7 mol 48 unq 6 iso 0 dist 6.46118 12.971 9.77004 18.4474 14.0438 7.32699 numMergedOcc 0
8 mol 48 unq 7 iso 0 dist 6.46118 12.971 9.77004 16.1999 10.6879 6.45933 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 8.38367 7.42165 7.36025 11.9145 13.0386 8.69371 numMergedOcc 0
10 mol 153 unq 0 iso 0 dist 9.50296 4.634 8.16336 9.47241 7.11128 6.18934 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 6.86905 5.61713 9.91332 10.3753 13.5072 5.90826 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 6.86905 5.61713 9.91332 11.3171 10.1453 8.75412 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 8.9281 4.76162 9.38713 6.23348 7.82195 5.7671 numMergedOcc 0
14 mol 251 unq 0 iso 0 dist 5.63943 3.46172 6.63516 9.71053 4.77397 9.20256 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 7.82276 3.9472 7.33027 9.03169 5.79293 9.26331 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 5.81967 3.42654 5.14151 9.71904 5.72619 7.7096 numMergedOcc 0
17 mol 265 unq 1 iso 0 dist 9.19106 5.12694 5.14151 12.0329 5.72619 7.7096 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 6.87275 4.32613 7.45915 7.99979 9.80648 5.35362 numMergedOcc 0
19 mol 278 unq 1 iso 0 dist 7.02416 3.64811 7.45915 8.0742 9.80648 5.35362 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 5.78449 9.8348 8.91437 7.11407 5.2842 9.33601 numMergedOcc 0
